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3-PENTAFLUOROANILINO-6-PENTAFLUOROPHENOXY-2,4,5,6-TETRAFLUORO-2,4-CYCLOHEXADIEN-1-ONE, TRIETHYLAMMONIUM SALT
SpectraBase Compound ID KL00mRYY3DQ
InChI InChI=1S/C18HF14NO2.C6H15N/c19-1-3(21)7(25)13(8(26)4(1)22)33-14-11(29)16(31)18(32,17(34)12(14)30)35-15-9(27)5(23)2(20)6(24)10(15)28;1-4-7(5-2)6-3/h(H,33,34);4-6H2,1-3H3
InChIKey HPMKWPGHSDCERE-UHFFFAOYSA-N
Mol Weight 630.38 g/mol
Molecular Formula C24H16F14N2O2
Exact Mass 630.098822 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AZBJdabwF4A
Name 3-PENTAFLUOROANILINO-6-PENTAFLUOROPHENOXY-2,4,5,6-TETRAFLUORO-2,4-CYCLOHEXADIEN-1-ONE, TRIETHYLAMMONIUM SALT
Comments C=40%
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C24H16F14N2O2
InChI InChI=1S/C18HF14NO2.C6H15N/c19-1-3(21)7(25)13(8(26)4(1)22)33-14-11(29)16(31)18(32,17(34)12(14)30)35-15-9(27)5(23)2(20)6(24)10(15)28;1-4-7(5-2)6-3/h(H,33,34);4-6H2,1-3H3
InChIKey HPMKWPGHSDCERE-UHFFFAOYSA-N
Instrument Name Varian A56/60A
Literature Reference V.N.KOVTONYUK, L.S.KOBRINA, G.G.YAKOBSON (1988) Zhurn.Org.Khim.(Russ. Lang.):v.24, N9, 1952-1959.
NMR Standard C6F6
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2H3N acetonitrile